1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone

C17H23FN2O — CID 110708885

IUPAC1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C17H23FN2O/c18-15-7-5-14(6-8-15)13-17(21)20-11-9-19(10-12-20)16-3-1-2-4-16/h5-8,16H,1-4,9-13H2
InChIKeyWLLUPSQMFPUAOG-UHFFFAOYSA-N
MW290.38 g/mol
LogP2.45
Rot. Bonds3

About 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone

1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone (PubChem CID 110708885) has the molecular formula C17H23FN2O and a molecular weight of 290.38 g/mol. Its IUPAC name is 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone.

Molecular Properties

Compound Name1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone
PubChem CID110708885
Molecular FormulaC17H23FN2O
Molecular Weight290.38 g/mol
Exact Mass290.18
IUPAC Name1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C17H23FN2O/c18-15-7-5-14(6-8-15)13-17(21)20-11-9-19(10-12-20)16-3-1-2-4-16/h5-8,16H,1-4,9-13H2
InChIKeyWLLUPSQMFPUAOG-UHFFFAOYSA-N
XLogP2.45
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.38
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]ethanone
CID 110868312
2-(4-fluorophenyl)-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone
CID 110868488
2-(4-fluorophenyl)-1-[4-[2-(4-fluorophenyl)acetyl]-1,4-diazepan-1-yl]ethanone
CID 110798689
1-(4-cyclohexylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone
CID 1247704
3-cyclohexyl-1-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]propan-1-one
CID 108533931
1-(4-cyclohexylpiperazin-1-yl)-2-(2-fluorophenyl)ethanone
CID 113073065
N-cyclopentyl-4-[2-(4-fluorophenyl)acetyl]-1,4-diazepane-1-carboxamide
CID 110811571
2-(4-fluorophenyl)-1-(3-piperazin-1-ylazetidin-1-yl)ethanone
CID 66195575
1-(4-cyclopentyl-1,4-diazepan-1-yl)-4-(4-fluorophenyl)butane-1,4-dione
CID 70754899
1-[4-[2-(4-chlorophenyl)acetyl]-1,4-diazepan-1-yl]-2-(4-fluorophenyl)ethanone
CID 110359111
1-[2-(4-cyclobutylpiperazin-1-yl)-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-7-yl]-2-(4-fluorophenyl)ethanone
CID 59670212
2-(4-fluorophenyl)-1-(3-piperazin-1-ylpyrrolidin-1-yl)ethanone;hydrochloride
CID 120995454

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone?
The IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone (CID 110708885) is 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone.
What is the SMILES notation for 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone?
The canonical SMILES for 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone is O=C(Cc1ccc(F)cc1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone?
The InChIKey is WLLUPSQMFPUAOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O/c18-15-7-5-14(6-8-15)13-17(21)20-11-9-19(10-12-20)16-3-1-2-4-16/h5-8,16H,1-4,9-13H2.
What are the key properties of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone?
1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone has a molecular weight of 290.38 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentylpiperazin-1-yl)-2-(4-fluorophenyl)ethanone is sourced from PubChem (CID 110708885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).